[2-(1,3-dioxan-2-yl)-2-methyl-propyl] 3-(3-methyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: [2-(1,3-dioxan-2-yl)-2-methyl-propyl] 3-(3-methyl-4-oxidanyl-phenyl)propanoate Openeye Name: [2-(1,3-dioxan-2-yl)-2-methyl-propyl] 3-(4-hydroxy-3-methyl-phenyl)propanoate CAS Name: 3-(4-hydroxy-3-methylphenyl)propanoic acid [2-(1,3-dioxan-2-yl)-2-methylpropyl] ester IUPAC Name: [2-(1,3-dioxan-2-yl)-2-methylpropyl] 3-(4-hydroxy-3-methylphenyl)propanoate Traditional Name: 3-(4-hydroxy-3-methyl-phenyl)propionic acid [2-(1,3-dioxan-2-yl)-2-methyl-propyl] ester Formula: C18H26O5 MolecularWeight: 322.39604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCC(=O)OCC(C)(C)C2OCCCO2)O

Isomeric SMILES

CC1=C(C=CC(=C1)CCC(=O)OCC(C)(C)C2OCCCO2)O

InChI

InChI=1S/C18H26O5/c1-13-11-14(5-7-15(13)19)6-8-16(20)23-12-18(2,3)17-21-9-4-10-22-17/h5,7,11,17,19H,4,6,8-10,12H2,1-3H3